SCHEMBL8411151

SCHEMBL8411151

CCOC(=O)C(=NOC(C)=O)C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
LMNA P02545 2/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPT P10636 3/20 0.42
GLO1 Q04760 1/20 0.42
ALOX15 P16050 1/20 0.41
NPSR1 Q6W5P4 1/20 0.38
ABCB1 P08183 1/20 0.37
TSHR P16473 2/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
SOAT1 P35610 1/20 0.36
EGLN1 Q9GZT9 1/20 0.35
PLIN1 O60240 1/20 0.34
POLB P06746 1/20 0.34
PLIN5 Q00G26 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8339074 0.92 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL25405030 0.83 MAPT (0.52) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL11321817 0.83 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL8825077 0.81 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL11329782 0.81 ALOX15 (0.39) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL8825080 0.81 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL6934179 0.79 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL8584723 0.78 TSHR (0.52) ALDH1A1MAPTNPSR1TSHRMEN1
SCHEMBL4836138 0.77 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10MAPTGLO1
SCHEMBL11325447 0.76 GLO1 (0.41) ALDH1A1LMNAHSD17B10MAPTGLO1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811602-B1 Process for the preparation of salts of the aminomalonic ester HUELS CHEMISCHE WERKE AG (DE) 1999-07-28 EP disclosed
US-5847197-A Process for the preparation of aminomalonic acid ester salts HUELS AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
EP-0811602-A1 Process for the preparation of salts of the aminomalonic ester HÜLS AKTIENGESELLSCHAFT (DE) 1997-12-10 EP disclosed